3-[[4-[1-(4-prop-2-enoxyphenoxy)heptyl]phenyl]carbonylamino]propanoic acid

Systemtic Name: 3-[[4-[1-(4-prop-2-enoxyphenoxy)heptyl]phenyl]carbonylamino]propanoic acid Openeye Name: 3-[[4-[1-(4-allyloxyphenoxy)heptyl]benzoyl]amino]propanoic acid CAS Name: 3-[[oxo-[4-[1-(4-prop-2-enoxyphenoxy)heptyl]phenyl]methyl]amino]propanoic acid IUPAC Name: 3-[[4-[1-(4-prop-2-enoxyphenoxy)heptyl]benzoyl]amino]propanoic acid Traditional Name: 3-[[4-[1-(4-allyloxyphenoxy)heptyl]benzoyl]amino]propionic acid Formula: C26H33NO5 MolecularWeight: 439.54392

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C1=CC=C(C=C1)C(=O)NCCC(=O)O)OC2=CC=C(C=C2)OCC=C

Isomeric SMILES

CCCCCCC(C1=CC=C(C=C1)C(=O)NCCC(=O)O)OC2=CC=C(C=C2)OCC=C

InChI

InChI=1S/C26H33NO5/c1-3-5-6-7-8-24(32-23-15-13-22(14-16-23)31-19-4-2)20-9-11-21(12-10-20)26(30)27-18-17-25(28)29/h4,9-16,24H,2-3,5-8,17-19H2,1H3,(H,27,30)(H,28,29)